2-[2-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]ethanenitrile

Systemtic Name: 2-[2-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]ethanenitrile Openeye Name: 2-[2-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]acetonitrile CAS Name: 2-[2-[(3-methyl-4-nitrophenoxy)methyl]phenyl]acetonitrile IUPAC Name: 2-[2-[(3-methyl-4-nitrophenoxy)methyl]phenyl]acetonitrile Traditional Name: 2-[2-[(3-methyl-4-nitro-phenoxy)methyl]phenyl]acetonitrile Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=CC=C2CC#N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=CC=C2CC#N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O3/c1-12-10-15(6-7-16(12)18(19)20)21-11-14-5-3-2-4-13(14)8-9-17/h2-7,10H,8,11H2,1H3